Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | APAF1 | O14727 | 1/20 | 0.49 |
| ▸ | FDPS | P14324 | 2/20 | 0.47 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.47 |
| ▸ | CYP11B1 | P15538 | 4/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.46 |
| ▸ | TNF | P01375 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.46 |
| ▸ | AGER | Q15109 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8413094 | 0.85 | APAF1 (0.55) | TDP1APAF1FDPSGGPS1CYP11B1 | |
| SCHEMBL19642850 | 0.76 | TDP1 (0.63) | TDP1APAF1FDPSGGPS1CYP11B1 | |
| SCHEMBL3079522 | 0.76 | TDP1 (0.68) | TDP1FDPSGGPS1CYP11B1CYP11B2 | |
| SCHEMBL3065318 | 0.76 | TDP1 (0.74) | TDP1FDPSGGPS1CYP11B1CYP11B2 | |
| SCHEMBL32660136 | 0.76 | TDP1 (0.74) | TDP1FDPSGGPS1CYP11B1CYP11B2 | |
| SCHEMBL230330 | 0.74 | TDP1 (0.78) | TDP1CYP11B1CYP11B2TNFLMNA | |
| SCHEMBL226221 | 0.73 | TDP1 (0.70) | TDP1APAF1CYP11B1CYP11B2TNF | |
| Bromide SCHEMBL10912945 | 0.73 | TDP1 (0.75) | TDP1CYP11B1CYP11B2TNFLMNA | |
| SCHEMBL13545635 | 0.72 | APAF1 (0.61) | TDP1APAF1FDPSGGPS1CYP11B1 | |
| SCHEMBL11543377 | 0.71 | TDP1 (0.51) | TDP1APAF1FDPSGGPS1CYP11B1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5859030-A | Substituted arylalkylthioalkylthiopyridines for use in the control of helicobacter bacteria | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 1999-01-12 | — | — | US | disclosed |